Chemical ID: 3906974

c1ccc(cc1)C(C(=O)NCc2ccc(cc2)F)N(c3ccc4c(c3)OCCO4)C(=O)Cn5c6ccccc6nn5
Chemical ID:
3906974
Name [?]:
2-[(2-benzotriazol-1-ylacetyl)-(2,5-dioxabicyclo[4.4.0]deca-7,9,11-trien-8-yl)amino]-N-[(4-fluorophenyl)methyl]-2-phenyl-acetamide
SMILES [?]:
c1ccc(cc1)C(C(=O)NCc2ccc(cc2)F)N(c3ccc4c(c3)OCCO4)C(=O)Cn5c6ccccc6nn5
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C31H26FN5O4
All Atoms:41
Heavy Atoms:41
Chiral Atoms:1
ZAP Information [?]
Total:12.6649
Area:775.183
Solvation:-6.71473
Coulombic:-65.1951
Bond Count [?]
All:46
Single:31
Double:15
Rotors:10
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:551.568
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:4.06
LogP (Chemaxon):4.46

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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